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(8S,20R,22.xi.)-Des-A,B-8-[(triethylsilyl)oxy]-22-(hydroxymethyl)-25-[(triethylsilyl)oxy]-cholestane
SpectraBase Compound ID BPrLFM4WR19
InChI InChI=1S/C31H64O3Si2/c1-11-35(12-2,13-3)33-29-18-17-22-31(10)27(19-20-28(29)31)25(7)26(24-32)21-23-30(8,9)34-36(14-4,15-5)16-6/h25-29,32H,11-24H2,1-10H3/t25-,26?,27-,28+,29+,31-/m1/s1
InChIKey PWERBLIYYPTPDN-MGWWHURRSA-N
Mol Weight 541.0 g/mol
Molecular Formula C31H64O3Si2
Exact Mass 540.439399 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EyRCFwtv6XI
Name (8S,20R,22.xi.)-Des-A,B-8-[(triethylsilyl)oxy]-22-(hydroxymethyl)-25-[(triethylsilyl)oxy]-cholestane
Appearance Colorless oil
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Formula C31H64O3Si2
InChI InChI=1S/C31H64O3Si2/c1-11-35(12-2,13-3)33-29-18-17-22-31(10)27(19-20-28(29)31)25(7)26(24-32)21-23-30(8,9)34-36(14-4,15-5)16-6/h25-29,32H,11-24H2,1-10H3/t25-,26?,27-,28+,29+,31-/m1/s1
InChIKey PWERBLIYYPTPDN-MGWWHURRSA-N
Ionization Type EI
Molecular Weight 541.020 g/mol
SMILES OCC([C@]([C@@]1([C@]2(CCC[C@@]([C@@]2(CC1)[H])(O[Si](CC)(CC)CC)[H])C)[H])(C)[H])CCC(O[Si](CC)(CC)CC)(C)C
SPLASH splash10-08mu-0943000000-e32ea7e4c97665ae2fe0
Sample Comments minor
Source of Spectrum US2012165300A1
Wiley ID 1849454